(1R,5S,7s)-7-isocyano-3λ⁶-thiabicyclo[3.3.1]nonane-3,3-dione
Structure Info
- Chemspace ID
- CSMB20471587185 (Enamine MADE)
- IUPAC Name
- (1R,5S,7s)-7-isocyano-3λ⁶-thiabicyclo[3.3.1]nonane-3,3-dione
- Mol formula
- C9H13NO2S
- Mol weight
- 199 Da
- Catalog Number(s)
- BBV-1320946290
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -2.26
- Heavy atoms count
- 13
- Rotatable bond count
- 0
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.88888888888889
- Polar surface area (Å)
- 39
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB20471587185
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